(E)-3-[4-(2-chloranylphenoxy)-3-nitro-phenyl]-2-methylsulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[4-(2-chloranylphenoxy)-3-nitro-phenyl]-2-methylsulfonyl-prop-2-enenitrile Openeye Name: (E)-3-[4-(2-chlorophenoxy)-3-nitro-phenyl]-2-methylsulfonyl-prop-2-enenitrile CAS Name: (E)-3-[4-(2-chlorophenoxy)-3-nitrophenyl]-2-methylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-[4-(2-chlorophenoxy)-3-nitrophenyl]-2-methylsulfonylprop-2-enenitrile Traditional Name: (E)-3-[4-(2-chlorophenoxy)-3-nitro-phenyl]-2-mesyl-acrylonitrile Formula: C16H11ClN2O5S MolecularWeight: 378.78694

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C(=CC1=CC(=C(C=C1)OC2=CC=CC=C2Cl)[N+](=O)[O-])C#N

Isomeric SMILES

CS(=O)(=O)/C(=C/C1=CC(=C(C=C1)OC2=CC=CC=C2Cl)[N+](=O)[O-])/C#N

InChI

InChI=1S/C16H11ClN2O5S/c1-25(22,23)12(10-18)8-11-6-7-16(14(9-11)19(20)21)24-15-5-3-2-4-13(15)17/h2-9H,1H3/b12-8+